Поиск публикаций Научные конференции и семинары Новости науки Научная сеть

 Найдено научных статей и публикаций: 2, для научной тематики: QNA


Связанные научные тематики:
тег
 
тег
 
тег
 
тег
 
тег
 
тег
 
тег
 
тег
 
тег
 



1.

QSAR modelling of rat acute toxicity on the basis of PASS prediction (публикация автора на scipeople)   

Lagunin A., Zakharov A., Filimonov D., Poroikov V. - Molecular Informatics , 2011
The method for QSAR modelling of rat acute toxicity based on the combination of QNA (Quantitative Neighbourhoods of Atoms) descriptors, PASS (Prediction of Activity Spectra for Substances) predictions and self-consistent regression (SCR) is...
2.

QNA based “Star Track” QSAR approach (публикация автора на scipeople)   

Filimonov D.A., Zakharov A.V., Lagunin A.A., Poroikov V.V. - SAR and QSAR in Environmental Research , 2009
In the existing QSAR methods any molecule is represented as a single point in many-dimensional space of molecular descriptors. We proposed a new QSAR approach based on Quantitative Neighbourhoods of Atoms (QNA) descriptors, which characterize each...